Acetonitrile → 1-{2-[2-(dimethylamino)ethyl]-1,3-dioxo-2,3-dihydro-1H-dibenzo[de,h]isoquinolin-11-yl}-3-[3-pyridyl]thiourea
Reaction equation
[CH3:35][C:36]#[N:37].[NH2:1][c:2]1[cH:3][cH:4][cH:5][c:6]2[cH:7][c:8]3[c:9]4[c:10]([cH:23][cH:24][cH:25]3)[C:11](=[O:22])[N:12]([CH2:17][CH2:18][N:19]([CH3:20])[CH3:21])[C:13](=[O:16])[c:14]4[c:15]12.[n:26]1[cH:27][c:28]([N:32]=[C:33]=[S:34])[cH:29][cH:30][cH:31]1>>[NH:1]([c:2]1[cH:3][cH:4][cH:5][c:6]2[cH:7][c:8]3[c:9]4[c:10]([cH:23][cH:24][cH:25]3)[C:11](=[O:22])[N:12]([CH2:17][CH2:18][N:19]([CH3:20])[CH3:21])[C:13](=[O:16])[c:14]4[c:15]12)[C:33]([NH:32][c:28]1[cH:27][n:26][cH:31][cH:30][cH:29]1)=[S:34]Participants
4
Sources & evidence
- ORD record
- ord-7159042ee5374076b2ee582d40c20bd2
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (7/10)
Reaction notes
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